Geometry & MOs

Info

ID:	214048
PubChem CID:	81065921
Reduced:	SN2O4C11H24 (1)
Stoich.:	AB2C4D11E24 (1)
Weight, g/mol:	319.064507
ΔH_f, kcal/mol:	-194.39
Dipole, Da:	8.44
IP(EA), eV:	-9.78(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(4-chloro-2-methylphenyl)sulfonylamino]methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCCCN(C)S(=O)(=O)NCC(CC)CC(=O)O

DOS

IR

Vibrations